2-[(E)-[2-chloro-3-[(Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-2-cyanoethenyl]cyclopent-2-en-1-ylidene]methyl]propanedinitrile,tetramethylazanium
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![2-[(E)-[2-chloro-3-[(Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-2-cyanoethenyl]cyclopent-2-en-1-ylidene]methyl]propanedinitrile,tetramethylazanium structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d4e88af06eed4402bb2def9474437332.png "2-[(E)-[2-chloro-3-[(Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-2-cyanoethenyl]cyclopent-2-en-1-ylidene]methyl]propanedinitrile,tetramethylazanium")
2-[(E)-[2-chloro-3-[(Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-2-cyanoethenyl]cyclopent-2-en-1-ylidene]methyl]propanedinitrile,tetramethylazanium
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CAS No:
140234-15-7
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Formula:
C23H22Cl2N5O+
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Chemical Name:
2-[(E)-[2-chloro-3-[(Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-2-cyanoethenyl]cyclopent-2-en-1-ylidene]methyl]propanedinitrile,tetramethylazanium
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Synonyms:
(2-Chloro-3-(2,2-dicyanoethenyl) 2-cyclopenten-1-ylidene-(5-chlorobenzoxazol-2-yl)cyanomethyl)tetramethylammonium salt; AB 670; Methanaminium,N,N,N-trimethyl-,salt with ((2-chloro-3-(2-(5-chloro-2-benzoxazolyl)-2-cyanoethenyl)-2-cyclopenten-1-ylidene)methyl)propanedinitrile (1:1); Albumin blue 670;
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CAS No:
2-[(E)-[2-chloro-3-[(Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-2-cyanoethenyl]cyclopent-2-en-1-ylidene]methyl]propanedinitrile,tetramethylazanium Basic Attributes
455.36000
454.1201407
Drug Information
(2-chloro-3-(2,2-dicyanoethenyl) 2-cyclopenten-1-ylidene-(5-chlorobenzoxazol-2-yl)cyanomethyl)tetramethylammonium salt
Computed Properties
Molecular Weight:455.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:454.1201407
Monoisotopic Mass:454.1201407
Topological Polar Surface Area:97.4
Heavy Atom Count:31
Formal Charge:1
Complexity:835
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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